Home Halogens 1-(2-bromobutanoyl)azepane

1-(2-bromobutanoyl)azepane

CAS No.:
1172770-52-3
Catalog Number:
AG008V4D
Molecular Formula:
C10H18BrNO
Molecular Weight:
248.1600
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$226
- +
5g
95%
In Stock USA
United States
$671
- +
Product Description
Catalog Number:
AG008V4D
Chemical Name:
1-(2-bromobutanoyl)azepane
CAS Number:
1172770-52-3
Molecular Formula:
C10H18BrNO
Molecular Weight:
248.1600
MDL Number:
MFCD03030383
IUPAC Name:
1-(azepan-1-yl)-2-bromobutan-1-one
InChI:
InChI=1S/C10H18BrNO/c1-2-9(11)10(13)12-7-5-3-4-6-8-12/h9H,2-8H2,1H3
InChI Key:
KUJYQJQCLSTBCS-UHFFFAOYSA-N
SMILES:
CCC(C(=O)N1CCCCCC1)Br
Properties
Complexity:
164  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
247.057g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
248.164g/mol
Monoisotopic Mass:
247.057g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  
Properties